Geometry & MOs

Info

ID:	75363
PubChem CID:	48423381
Reduced:	SN2O2C17H26 (1)
Stoich.:	AB2C2D17E26 (1)
Weight, g/mol:	410.145342
ΔH_f, kcal/mol:	-58.21
Dipole, Da:	4.97
IP(EA), eV:	-8.49(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-[1-[4-(trifluoromethoxy)phenyl]ethylamino]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(CNC(=O)C(C)OCC1CC1)N2CCC3=C(C2)C=CS3

DOS

IR

Vibrations