Geometry & MOs

Info

ID:	159222
PubChem CID:	57264440
Reduced:	NOCl4C6H7 (1)
Stoich.:	ABC4D6E7 (1)
Weight, g/mol:	200.17763
ΔH_f, kcal/mol:	-27.81
Dipole, Da:	3.33
IP(EA), eV:	-9.15(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3-dimethoxypropan-2-ylidene)heptane

Drug info:

PubChemData

Smile

CC1C(=CON1CC(Cl)(Cl)Cl)Cl

DOS

IR

Vibrations