Geometry & MOs

Info

ID:	443143
PubChem CID:	135257840
Reduced:	F2N2O3C19H20 (1)
Stoich.:	A2B2C3D19E20 (1)
Weight, g/mol:	414.215472
ΔH_f, kcal/mol:	-194.0
Dipole, Da:	7.01
IP(EA), eV:	-9.19(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(1R)-2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-1-phenylethyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@H](C1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)F)F

DOS

IR

Vibrations