Geometry & MOs

Info

ID:	136275
PubChem CID:	52010435
Reduced:	ON6C17H18 (1)
Stoich.:	AB6C17D18 (1)
Weight, g/mol:	327.115381
ΔH_f, kcal/mol:	79.41
Dipole, Da:	8.32
IP(EA), eV:	-10.02(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-propan-2-yltetrazol-5-yl)-N-(thiophen-2-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC(C)N1C(=NN=N1)C2=CC(=CC=C2)C(=O)NCC3=CC=CC=N3

DOS

IR

Vibrations