Geometry & MOs

Info

ID:	78834
PubChem CID:	49737845
Reduced:	SO2N6H18C20 (1)
Stoich.:	AB2C6D18E20 (1)
Weight, g/mol:	392.116778
ΔH_f, kcal/mol:	65.33
Dipole, Da:	4.3
IP(EA), eV:	-8.86(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(4-methylpyridin-2-yl)amino]-1,3-thiazol-4-yl]-N-[4-(tetrazol-1-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1)NC2=NC(=CS2)CC(=O)NCC3=NC(=NO3)C4=CC=CC=C4

DOS

IR

Vibrations