Geometry & MOs

Info

ID:	360416
PubChem CID:	127301061
Reduced:	SO2N4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	382.200491
ΔH_f, kcal/mol:	-36.25
Dipole, Da:	3.71
IP(EA), eV:	-8.72(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[3-(4-methylpyrazol-1-yl)piperidine-1-carbonyl]phenyl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2CCCN(C2)C(=O)CCN3C(=O)CSC4=CC=CC=C43

DOS

IR

Vibrations