Geometry & MOs

Info

ID:	380937
PubChem CID:	134971543
Reduced:	C19H30 (1)
Stoich.:	A19B30 (1)
Weight, g/mol:	386.318481
ΔH_f, kcal/mol:	27.71
Dipole, Da:	1.84
IP(EA), eV:	-7.87(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z)-5-[(1R,4aR,4bS,10aS)-2,4b,8,8,10a-pentamethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthren-1-yl]-3-methylpent-2-enoate

Drug info:

PubChemData

Smile

C[C@H]1CCC[C@]2(C1CC[C@@]3([C@@H]2CC=C(C3=C)C)C)C

DOS

IR

Vibrations