Geometry & MOs

Info

ID:	342536
PubChem CID:	127265691
Reduced:	N2C10H11 (2)
Stoich.:	A2B10C11 (2)
Weight, g/mol:	268.157563
ΔH_f, kcal/mol:	106.28
Dipole, Da:	5.99
IP(EA), eV:	-9.02(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methoxyphenyl)-N-methyl-N-(pyridin-4-ylmethyl)prop-2-en-1-amine

Drug info:

PubChemData

Smile

C1CN(CCN1CC=CC2=CC=C(C=C2)C#N)CC3=CN=CC=C3

DOS

IR

Vibrations