Geometry & MOs

Info

ID:	347421
PubChem CID:	127272270
Reduced:	O2N3C22H27 (1)
Stoich.:	A2B3C22D27 (1)
Weight, g/mol:	365.210327
ΔH_f, kcal/mol:	-56.6
Dipole, Da:	3.42
IP(EA), eV:	-9.01(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-benzylpiperidin-3-yl)-3-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]urea

Drug info:

PubChemData

Smile

CC(CNC(=O)N[C@@H]1[C@@H](CC2=CC=CC=C12)O)N3CCC4=CC=CC=C4C3

DOS

IR

Vibrations