Geometry & MOs

Info

ID:	350298
PubChem CID:	127277376
Reduced:	SO2N3C21H31 (1)
Stoich.:	AB2C3D21E31 (1)
Weight, g/mol:	391.225977
ΔH_f, kcal/mol:	-87.33
Dipole, Da:	3.44
IP(EA), eV:	-8.55(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)C(C)NC(=O)C(C2=CC=CC=C2)N3CCSCC3

DOS

IR

Vibrations