Geometry & MOs

Info

ID:	325446
PubChem CID:	126683312
Reduced:	N2O3H34C36 (1)
Stoich.:	A2B3C34D36 (1)
Weight, g/mol:	313.18305
ΔH_f, kcal/mol:	11.17
Dipole, Da:	4.0
IP(EA), eV:	-8.41(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(cyclopentylmethyl)phenyl]-2-phenylpyridine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C)OC)C2=NC=C(C=C2C)C3=C(C=C(C=N3)C4=CC(=C(C=C4)OC)OC)/C=C/C5=CC=CC=C5

DOS

IR

Vibrations