Geometry & MOs

Info

ID:	349668
PubChem CID:	127275820
Reduced:	N4O4C19H22 (1)
Stoich.:	A4B4C19D22 (1)
Weight, g/mol:	366.205576
ΔH_f, kcal/mol:	-91.26
Dipole, Da:	3.8
IP(EA), eV:	-9.07(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2,3-dihydro-1H-indene-4-carbonyl)piperidin-4-yl]methyl]-1-methylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C(=O)NCC2CCN(CC2)C(=O)C3=C4C(=CC=C3)OCO4

DOS

IR

Vibrations