Geometry & MOs

Info

ID:	247711
PubChem CID:	103072843
Reduced:	ON2C16H18 (1)
Stoich.:	AB2C16D18 (1)
Weight, g/mol:	219.173548
ΔH_f, kcal/mol:	23.7
Dipole, Da:	3.91
IP(EA), eV:	-8.8(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-(4,5,6,7-tetrahydrobenzimidazol-1-ylmethyl)prop-2-en-1-amine

Drug info:

PubChemData

Smile

C=C(CNC1CC1)CN2C=CC3=CC=CC=C3C2=O

DOS

IR

Vibrations