Geometry & MOs

Info

ID:	139499
PubChem CID:	52542915
Reduced:	ClFON2C13H18 (1)
Stoich.:	ABCD2E13F18 (1)
Weight, g/mol:	338.220557
ΔH_f, kcal/mol:	-102.73
Dipole, Da:	4.26
IP(EA), eV:	-8.99(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dipropoxyphenyl)-3-(3-ethoxypropyl)urea

Drug info:

PubChemData

Smile

CCCCCCNC(=O)NC1=C(C=C(C=C1)Cl)F

DOS

IR

Vibrations