Geometry & MOs

Info

ID:	78500
PubChem CID:	49693383
Reduced:	FO2N3C21H24 (1)
Stoich.:	AB2C3D21E24 (1)
Weight, g/mol:	375.141676
ΔH_f, kcal/mol:	-104.02
Dipole, Da:	5.95
IP(EA), eV:	-8.81(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-(2-fluorobenzoyl)piperidin-4-yl]methyl]-3-(thiophen-2-ylmethyl)urea

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)NCC2CCN(CC2)C(=O)C3=CC=CC=C3F

DOS

IR

Vibrations