Geometry & MOs

Info

ID:	161873
PubChem CID:	57392907
Reduced:	N3O3C9H11 (1)
Stoich.:	A3B3C9D11 (1)
Weight, g/mol:	327.125073
ΔH_f, kcal/mol:	-30.93
Dipole, Da:	7.73
IP(EA), eV:	-9.26(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-diphenyl-N-(2H-tetrazol-5-ylmethyl)prop-2-en-1-amine;hydrochloride

Drug info:

PubChemData

Smile

CC(=C1C=CC(=O)C=C1)NNC(=O)NO

DOS

IR

Vibrations