Geometry & MOs

Info

ID:	43862
PubChem CID:	10321898
Reduced:	N2F3O4H21C24 (1)
Stoich.:	A2B3C4D21E24 (1)
Weight, g/mol:	458.156575
ΔH_f, kcal/mol:	-236.55
Dipole, Da:	5.97
IP(EA), eV:	-9.52(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-morpholin-4-yl-3-(trifluoromethyl)phenyl]-3-(4-pyridin-4-yloxyphenyl)urea

Drug info:

PubChemData

Smile

CC1=NOC(=O)C2=C1C=C(C=C2)NC(=O)C(CC3=CCCCC4=CC=CC=C43)(C(F)(F)F)O

DOS

IR

Vibrations