Geometry & MOs

Info

ID:	75679
PubChem CID:	48423837
Reduced:	O4N5C21H27 (1)
Stoich.:	A4B5C21D27 (1)
Weight, g/mol:	334.200491
ΔH_f, kcal/mol:	-123.29
Dipole, Da:	4.25
IP(EA), eV:	-9.48(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(cyclopropylmethoxy)propanoyl]piperidin-4-yl]-1-methylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C(=O)NC2CCN(CC2)C(=O)C(CC3=CC=CC=C3)NC(=O)OC

DOS

IR

Vibrations