Geometry & MOs

Info

ID:	335771
PubChem CID:	127254633
Reduced:	FO2N5H14C15 (1)
Stoich.:	AB2C5D14E15 (1)
Weight, g/mol:	360.169859
ΔH_f, kcal/mol:	-47.03
Dipole, Da:	2.75
IP(EA), eV:	-8.88(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1-methylindol-3-yl)ethyl]-4-(tetrazol-1-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NN1)NC(=O)C2=CNC3=C(C2=O)C=CC=C3F

DOS

IR

Vibrations