Geometry & MOs

Info

ID:	269475
PubChem CID:	103617667
Reduced:	N2O2F3C7H13 (1)
Stoich.:	A2B2C3D7E13 (1)
Weight, g/mol:	254.048996
ΔH_f, kcal/mol:	-272.63
Dipole, Da:	4.53
IP(EA), eV:	-10.06(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2,2-trifluoroethyl)-3-(3,3,3-trifluoro-2-hydroxypropyl)urea

Drug info:

PubChemData

Smile

CC(C)NC(=O)NCC(C(F)(F)F)O

DOS

IR

Vibrations