Geometry & MOs

Info

ID:	367589
PubChem CID:	127325078
Reduced:	SO3N4C18H28 (1)
Stoich.:	AB3C4D18E28 (1)
Weight, g/mol:	384.092597
ΔH_f, kcal/mol:	-122.79
Dipole, Da:	4.93
IP(EA), eV:	-8.79(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dimethyl-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=O)N1CCC(=O)N2CCN(CC2)C(C)C(=O)NC3CC3)C

DOS

IR

Vibrations