Geometry & MOs

Info

ID:	55609
PubChem CID:	17395655
Reduced:	FN2O3C18H19 (1)
Stoich.:	AB2C3D18E19 (1)
Weight, g/mol:	334.132885
ΔH_f, kcal/mol:	-151.84
Dipole, Da:	2.13
IP(EA), eV:	-9.54(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)-3-[(2,4,5-trimethoxyphenyl)methyl]urea

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CNC(=O)CN2C(=O)C3CC=CCC3C2=O)F

DOS

IR

Vibrations