Geometry & MOs

Info

ID:	179018
PubChem CID:	76420516
Reduced:	O5C31H42 (1)
Stoich.:	A5B31C42 (1)
Weight, g/mol:	548.361408
ΔH_f, kcal/mol:	-211.23
Dipole, Da:	6.78
IP(EA), eV:	-8.48(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicen-2-yl)methyl piperazine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(=O)C=C2C1=CC=C3C2(CCC4(C3(CCC5(C4CC(CC5)(C)COC(=O)OC)C)C)C)C)O

DOS

IR

Vibrations