Geometry & MOs

Info

ID:	345565
PubChem CID:	127269865
Reduced:	FO2N5C18H26 (1)
Stoich.:	AB2C5D18E26 (1)
Weight, g/mol:	303.104148
ΔH_f, kcal/mol:	-115.02
Dipole, Da:	5.97
IP(EA), eV:	-8.25(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-benzothiophen-3-ylmethyl)-3-(2-oxopiperidin-3-yl)urea

Drug info:

PubChemData

Smile

C1CC(C(=O)NC1)NC(=O)NCCN2CCN(CC2)C3=CC=C(C=C3)F

DOS

IR

Vibrations