Geometry & MOs

Info

ID:	154552
PubChem CID:	56314014
Reduced:	F3N3O4C23H24 (1)
Stoich.:	A3B3C4D23E24 (1)
Weight, g/mol:	436.172225
ΔH_f, kcal/mol:	-271.97
Dipole, Da:	4.41
IP(EA), eV:	-9.19(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(carbamoylamino)-N-[2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]benzamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC(C1=CC=C(C=C1)C(F)(F)F)N2CCOCC2)N3C4=CC=CC=C4OC3=O

DOS

IR

Vibrations