Geometry & MOs

Info

ID:	154108
PubChem CID:	56313496
Reduced:	FO2N3C26H32 (1)
Stoich.:	AB2C3D26E32 (1)
Weight, g/mol:	477.175599
ΔH_f, kcal/mol:	-76.59
Dipole, Da:	5.52
IP(EA), eV:	-8.84(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylbutan-2-yl)-1-[3-[(4-methylphenyl)sulfamoyl]thiophene-2-carbonyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CN2CCC(CC2)NC(=O)/C=C/C3=CC(=C(C=C3)OC4=CN=CC=C4)F

DOS

IR

Vibrations