Geometry & MOs

Info

ID:	144437
PubChem CID:	53368547
Reduced:	O3N4C22H26 (1)
Stoich.:	A3B4C22D26 (1)
Weight, g/mol:	336.133474
ΔH_f, kcal/mol:	-19.05
Dipole, Da:	7.37
IP(EA), eV:	-8.47(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-carbamoylphenyl)-3,4-dimethyl-2-(tetrazol-1-yl)benzamide

Drug info:

PubChemData

Smile

CC1=NOC2=C1C(=CC(=N2)C(C)C)C(=O)N3CCN(CC3)C4=CC=CC=C4OC

DOS

IR

Vibrations