Geometry & MOs

Info

ID:	78552
PubChem CID:	49693597
Reduced:	SN3O4C17H21 (1)
Stoich.:	AB3C4D17E21 (1)
Weight, g/mol:	389.027076
ΔH_f, kcal/mol:	-91.78
Dipole, Da:	6.7
IP(EA), eV:	-9.36(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chlorothiophen-2-yl)sulfonyl-N-(3-methyl-1,2-oxazol-5-yl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=NO3)C

DOS

IR

Vibrations