Geometry & MOs

Info

ID:	336222
PubChem CID:	127255229
Reduced:	O3N4C12H14 (1)
Stoich.:	A3B4C12D14 (1)
Weight, g/mol:	399.136511
ΔH_f, kcal/mol:	-52.49
Dipole, Da:	3.74
IP(EA), eV:	-8.61(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)-4,5-dimethyl-2-(tetrazol-1-yl)thiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C2=CC(=O)C(=CN2)OC

DOS

IR

Vibrations