Geometry & MOs

Info

ID:	61258
PubChem CID:	26707509
Reduced:	ON2H10C11 (2)
Stoich.:	AB2C10D11 (2)
Weight, g/mol:	446.162391
ΔH_f, kcal/mol:	39.78
Dipole, Da:	4.41
IP(EA), eV:	-8.88(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopropylcarbamoyl)phenyl]-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC1NC(=O)C2=CC=CC=C2NC(=O)/C=C/C3=CN(N=C3)C4=CC=CC=C4

DOS

IR

Vibrations