Geometry & MOs

Info

ID:	27428
PubChem CID:	821309
Reduced:	O2C15H26 (1)
Stoich.:	A2B15C26 (1)
Weight, g/mol:	236.17763
ΔH_f, kcal/mol:	-116.23
Dipole, Da:	2.4
IP(EA), eV:	-9.67(2.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1aS,3aS,7R,7aS,7bS)-7-hydroxy-1,1,3a,7-tetramethyl-3,4,5,6,7a,7b-hexahydro-1aH-cyclopropa[a]naphthalen-2-one

Drug info:

PubChemData

Smile

C[C@H]1CC[C@H]([C@]2([C@@H]1[C@@H]3[C@@H](C3(C)C)CC2)CO)O

DOS

IR

Vibrations