Geometry & MOs

Info

ID:	216794
PubChem CID:	85086784
Reduced:	N2C21H22 (1)
Stoich.:	A2B21C22 (1)
Weight, g/mol:	302.247047
ΔH_f, kcal/mol:	136.93
Dipole, Da:	3.48
IP(EA), eV:	-7.76(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(12-azido-11-methyldodecyl)pyridine

Drug info:

PubChemData

Smile

C1CN2CCC1C3=NC(C(C32)C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations