Geometry & MOs

Info

ID:	31710
PubChem CID:	860967
Reduced:	ON6C16H16 (1)
Stoich.:	AB6C16D16 (1)
Weight, g/mol:	323.138225
ΔH_f, kcal/mol:	88.22
Dipole, Da:	6.87
IP(EA), eV:	-9.61(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethylphenyl)-3-methoxy-4-(tetrazol-1-yl)benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNC(=O)CN2N=C(N=N2)C3=CN=CC=C3

DOS

IR

Vibrations