Geometry & MOs

Info

ID:	52730
PubChem CID:	12015797
Reduced:	NC7H11 (2)
Stoich.:	AB7C11 (2)
Weight, g/mol:	240.162649
ΔH_f, kcal/mol:	5.52
Dipole, Da:	3.88
IP(EA), eV:	-9.18(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-phenylethyl)-3-pyridin-4-ylpropan-1-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)CCNCC2=CC=NC=C2

DOS

IR

Vibrations