Geometry & MOs

Info

ID:	357373
PubChem CID:	127294006
Reduced:	N2O2C17H20 (1)
Stoich.:	A2B2C17D20 (1)
Weight, g/mol:	397.112999
ΔH_f, kcal/mol:	-33.07
Dipole, Da:	6.41
IP(EA), eV:	-9.41(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-piperidin-1-ylsulfonylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CCNC(=O)C2=CC=CC3=C2CCC3

DOS

IR

Vibrations