Geometry & MOs

Info

ID:	207219
PubChem CID:	80361884
Reduced:	ON2C14H16 (1)
Stoich.:	AB2C14D16 (1)
Weight, g/mol:	212.138559
ΔH_f, kcal/mol:	1.07
Dipole, Da:	1.48
IP(EA), eV:	-8.4(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(aminomethyl)pentan-3-yl]-2H-tetrazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CC2CC1CC2C3=NC4=C(C=CC=C4O3)N

DOS

IR

Vibrations