Geometry & MOs

Info

ID:	247122
PubChem CID:	103067966
Reduced:	ClNOC9H18 (1)
Stoich.:	ABCD9E18 (1)
Weight, g/mol:	221.100498
ΔH_f, kcal/mol:	-63.87
Dipole, Da:	3.67
IP(EA), eV:	-9.2(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(chloromethyl)prop-2-enyl]-N-methyl-4-methylsulfanylbutan-2-amine

Drug info:

PubChemData

Smile

CC(CCN(C)CC(=C)CCl)O

DOS

IR

Vibrations