Geometry & MOs

Info

ID:	175265
PubChem CID:	75876621
Reduced:	ON2F3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	398.214033
ΔH_f, kcal/mol:	-207.46
Dipole, Da:	7.91
IP(EA), eV:	-9.2(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-piperidin-1-ylphenyl)-3-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)urea

Drug info:

PubChemData

Smile

CCC1CCCN(C1)C(=O)NC2=CC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations