Geometry & MOs

Info

ID:	188465
PubChem CID:	77721659
Reduced:	N3O8C20H35 (1)
Stoich.:	A3B8C20D35 (1)
Weight, g/mol:	425.233286
ΔH_f, kcal/mol:	-422.13
Dipole, Da:	7.44
IP(EA), eV:	-9.88(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(10,13-dimethyl-6,17-dioxo-2,3,4,5,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl) 3-aminobutanoate;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCCC(C(=O)O)NC(=O)OC(C)(C)C.C1CC(=O)NC1=O

DOS

IR

Vibrations