Geometry & MOs

Info

ID:	198888
PubChem CID:	79167746
Reduced:	NCl2C10H17 (1)
Stoich.:	AB2C10D17 (1)
Weight, g/mol:	287.08437
ΔH_f, kcal/mol:	-26.45
Dipole, Da:	1.99
IP(EA), eV:	-9.12(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(2,3-dichloroprop-2-enoxy)phenyl]methyl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

CC1(CCCC1)CNCC(=CCl)Cl

DOS

IR

Vibrations