Geometry & MOs

Info

ID:	190340
PubChem CID:	77989895
Reduced:	FN2O3C19H21 (1)
Stoich.:	AB2C3D19E21 (1)
Weight, g/mol:	471.118159
ΔH_f, kcal/mol:	-116.92
Dipole, Da:	3.84
IP(EA), eV:	-9.36(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-fluorophenyl)methyl]-3-[[4-(trifluoromethyl)phenyl]-[3-(trifluoromethyl)pyridin-2-yl]methyl]urea

Drug info:

PubChemData

Smile

CCOC1=NC=C(C=C1)C(CO)NC(=O)C2CC2C3=CC=C(C=C3)F

DOS

IR

Vibrations