Geometry & MOs

Info

ID:	140041
PubChem CID:	52635316
Reduced:	ClO3N4C22H25 (1)
Stoich.:	AB3C4D22E25 (1)
Weight, g/mol:	356.173607
ΔH_f, kcal/mol:	-90.23
Dipole, Da:	5.77
IP(EA), eV:	-8.04(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-tert-butyl-2-(2-methyl-5-nitrophenoxy)acetamide

Drug info:

PubChemData

Smile

C[C@@]1(C(=O)N(C(=O)N1)CC(=O)NCCCN(C)C2=CC=CC=C2)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations