Geometry & MOs

Info

ID:

164126

PubChem CID:

74382049

Reduced:

SN3O7C28H39 (1)

Stoich.:

AB3C7D28E39 (1)

Weight, g/mol:

546.251206

ΔHf, kcal/mol:

-270.96

Dipole, Da:

2.47

IP(EA), eV:

 -9.09(-0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl N-[3-amino-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC2C(=O)OCC2(C)C)N)S(=O)(=O)C3=CC=C(C=C3)OC

DOS

IR

Vibrations