Geometry & MOs

Info

ID:	199805
PubChem CID:	79298334
Reduced:	ClC12H23 (1)
Stoich.:	AB12C23 (1)
Weight, g/mol:	224.133178
ΔH_f, kcal/mol:	-69.49
Dipole, Da:	2.21
IP(EA), eV:	-10.28(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloro-2,5-dimethylhexan-3-yl)benzene

Drug info:

PubChemData

Smile

CCC1CCCC(C1)C(C(C)C)Cl

DOS

IR

Vibrations