Geometry & MOs

Info

ID:	9668
PubChem CID:	92138
Reduced:	OC15H26 (1)
Stoich.:	AB15C26 (1)
Weight, g/mol:	222.198365
ΔH_f, kcal/mol:	-68.1
Dipole, Da:	2.07
IP(EA), eV:	-9.53(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1R,3S,4S)-4-ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexyl]propan-2-ol

Drug info:

PubChemData

Smile

CC(=C)[C@@H]1C[C@@H](CC[C@@]1(C)C=C)C(C)(C)O

DOS

IR

Vibrations