Geometry & MOs

Info

ID:	4356
PubChem CID:	11276
Reduced:	O4C23H34 (1)
Stoich.:	A4B23C34 (1)
Weight, g/mol:	374.24571
ΔH_f, kcal/mol:	-216.78
Dipole, Da:	2.94
IP(EA), eV:	-9.38(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OCC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C

DOS

IR

Vibrations