Geometry & MOs

Info

ID:	352153
PubChem CID:	127283221
Reduced:	O2N3C23H27 (1)
Stoich.:	A2B3C23D27 (1)
Weight, g/mol:	398.166414
ΔH_f, kcal/mol:	-45.34
Dipole, Da:	4.4
IP(EA), eV:	-8.9(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-piperidin-1-ylsulfonylphenyl)methyl]-2,3-dihydro-1H-indene-1-carboxamide

Drug info:

PubChemData

Smile

CN1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3CCC4=CC=CC=C34

DOS

IR

Vibrations