Geometry & MOs

Info

ID:	140760
PubChem CID:	52755204
Reduced:	N2O2F3C19H21 (1)
Stoich.:	A2B2C3D19E21 (1)
Weight, g/mol:	386.10089
ΔH_f, kcal/mol:	-209.24
Dipole, Da:	2.68
IP(EA), eV:	-9.14(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-chlorophenyl)methyl]-3-[(1S)-1-[4-(2,2,2-trifluoroethoxy)phenyl]ethyl]urea

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)NC(=O)N[C@H](C)C2=CC=C(C=C2)OCC(F)(F)F

DOS

IR

Vibrations