Geometry & MOs

Info

ID:	14483
PubChem CID:	412798
Reduced:	ClNC9H18 (1)
Stoich.:	ABC9D18 (1)
Weight, g/mol:	175.112777
ΔH_f, kcal/mol:	-35.45
Dipole, Da:	3.02
IP(EA), eV:	-8.8(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloroethyl)-4-methylazepane

Drug info:

PubChemData

Smile

CC1CCCN(CC1)CCCl

DOS

IR

Vibrations