Geometry & MOs

Info

ID:	48172
PubChem CID:	10537685
Reduced:	SC15H22 (1)
Stoich.:	AB15C22 (1)
Weight, g/mol:	234.013193
ΔH_f, kcal/mol:	-26.66
Dipole, Da:	1.97
IP(EA), eV:	-8.31(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-dichloro-4-methyl-6,7,8,8a-tetrahydro-5H-isophosphinoline

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1S)C(CCC2(C)C)(C)C

DOS

IR

Vibrations