Geometry & MOs

Info

ID:	336303
PubChem CID:	127255310
Reduced:	SO2N5C19H19 (1)
Stoich.:	AB2C5D19E19 (1)
Weight, g/mol:	357.010553
ΔH_f, kcal/mol:	43.23
Dipole, Da:	7.15
IP(EA), eV:	-8.32(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCCN2CC(=O)C(=C2N)C3=NC(=CS3)C4=CC=CC=C4

DOS

IR

Vibrations