Geometry & MOs

Info

ID:	62956
PubChem CID:	26737788
Reduced:	SN3O5C18H19 (1)
Stoich.:	AB3C5D18E19 (1)
Weight, g/mol:	389.1223
ΔH_f, kcal/mol:	-93.12
Dipole, Da:	4.01
IP(EA), eV:	-9.4(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-amino-2-oxoethoxy)-3,5-dimethoxy-N-(2-methyl-3-nitrophenyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CCNC(=O)CCC(=O)C2=CC=CS2

DOS

IR

Vibrations