Geometry & MOs

Info

ID:	335511
PubChem CID:	127254373
Reduced:	SN4O4H18C20 (1)
Stoich.:	AB4C4D18E20 (1)
Weight, g/mol:	289.088498
ΔH_f, kcal/mol:	-49.07
Dipole, Da:	7.32
IP(EA), eV:	-8.13(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-phenoxyacetamide

Drug info:

PubChemData

Smile

CC1=C(C2=C(N1)C=CC(=C2)OC)C3=CSC(=N3)NC(=O)C4=CC(=O)C(=CN4)OC

DOS

IR

Vibrations