Geometry & MOs

Info

ID:	392781
PubChem CID:	135017944
Reduced:	ON2H14C16 (1)
Stoich.:	AB2C14D16 (1)
Weight, g/mol:	398.184172
ΔH_f, kcal/mol:	11.16
Dipole, Da:	2.75
IP(EA), eV:	-8.68(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[2-[2-(1,3-dioxolan-2-yl)phenyl]anilino]-2-oxoethyl]carbamate

Drug info:

PubChemData

Smile

C[C@H]1C(=O)N2[C@@H](N1)C3=CC=CC=C3C4=CC=CC=C42

DOS

IR

Vibrations