Geometry & MOs

Info

ID:	200097
PubChem CID:	79348118
Reduced:	N3C14H17 (1)
Stoich.:	A3B14C17 (1)
Weight, g/mol:	216.126263
ΔH_f, kcal/mol:	79.14
Dipole, Da:	3.37
IP(EA), eV:	-8.62(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[3-(ethylamino)prop-1-enyl]phenoxy]acetonitrile

Drug info:

PubChemData

Smile

CCNCC=CC1=CN(N=C1)C2=CC=CC=C2

DOS

IR

Vibrations