Geometry & MOs

Info

ID:	73626
PubChem CID:	48419540
Reduced:	N3O3C23H31 (1)
Stoich.:	A3B3C23D31 (1)
Weight, g/mol:	405.099457
ΔH_f, kcal/mol:	-116.92
Dipole, Da:	4.24
IP(EA), eV:	-8.3(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-[3-[[2-(4-nitrophenyl)sulfinylacetyl]amino]phenoxy]acetamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)C(=O)C2CCN(CC2)C(=O)CC3=CN(C4=CC=CC=C43)C

DOS

IR

Vibrations