Geometry & MOs

Info

ID:	326254
PubChem CID:	126687240
Reduced:	FNO2C24H30 (1)
Stoich.:	ABC2D24E30 (1)
Weight, g/mol:	174.117528
ΔH_f, kcal/mol:	-127.63
Dipole, Da:	1.97
IP(EA), eV:	-8.76(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-6-chloro-3-ethyl-2,4-dimethylhex-2-ene

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)CC2(C[C@@H]3CN(C[C@@H]3C2)CC(C)C4=CC=C(C=C4)O)O

DOS

IR

Vibrations