Geometry & MOs

Info

ID:	131550
PubChem CID:	51224410
Reduced:	NOC5H7 (3)
Stoich.:	ABC5D7 (3)
Weight, g/mol:	279.148396
ΔH_f, kcal/mol:	-120.92
Dipole, Da:	3.0
IP(EA), eV:	-8.9(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-N-[(1-phenyltetrazol-5-yl)methyl]aniline

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC(=O)NC(=O)NC2=CC=CC=C2

DOS

IR

Vibrations