Geometry & MOs

Info

ID:	353254
PubChem CID:	127284434
Reduced:	N4O5C20H20 (1)
Stoich.:	A4B5C20D20 (1)
Weight, g/mol:	391.225977
ΔH_f, kcal/mol:	-157.64
Dipole, Da:	4.67
IP(EA), eV:	-9.3(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-(2,3-dihydro-1H-indene-1-carbonyl)piperidin-3-yl]methyl]-3-(4-methylphenyl)urea

Drug info:

PubChemData

Smile

CC1C(=O)NC2=CC=CC(=C2O1)C(=O)N3CCN(CC3)C(=O)C4=CNC(=O)C=C4

DOS

IR

Vibrations