Geometry & MOs

Info

ID:

164679

PubChem CID:

74436639

Reduced:

SN4O6C34H44 (1)

Stoich.:

AB4C6D34E44 (1)

Weight, g/mol:

740.520034

ΔHf, kcal/mol:

-195.76

Dipole, Da:

8.17

IP(EA), eV:

 -9.16(-0.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-[2-[[2-[(1-tert-butylazetidine-2-carbonyl)amino]-3,3-dimethylbutanoyl]amino]-3,3-dimethylbutanoyl]-N-[1-(cyclopropylamino)-1,2-dioxohexan-3-yl]-10,10-dimethyl-7-azadispiro[3.0.45.14]decane-8-carboxamide

Drug info:

PubChemData

Smile

CC(CCCC(CO)N(CC1CC1)S(=O)(=O)C2=CC=C(C=C2)N)NC(=O)C(C(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)OC

DOS

IR

Vibrations