Geometry & MOs

Info

ID:	144433
PubChem CID:	53368209
Reduced:	SN3O5C18H21 (1)
Stoich.:	AB3C5D18E21 (1)
Weight, g/mol:	332.138559
ΔH_f, kcal/mol:	-149.54
Dipole, Da:	7.92
IP(EA), eV:	-8.56(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-(1-methylindol-4-yl)-3-(tetrazol-1-yl)benzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC(CCSC)C(=O)O

DOS

IR

Vibrations