Geometry & MOs

Info

ID:	158050
PubChem CID:	56459440
Reduced:	N5O5H19C22 (1)
Stoich.:	A5B5C19D22 (1)
Weight, g/mol:	409.122003
ΔH_f, kcal/mol:	-109.31
Dipole, Da:	5.28
IP(EA), eV:	-8.48(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-fluoro-3-piperidin-1-ylsulfonylbenzoyl)amino]-5-methyl-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=C(NN=C4C(=O)N)C

DOS

IR

Vibrations