Geometry & MOs

Info

ID:	276850
PubChem CID:	103825458
Reduced:	O2S2N3C12H19 (1)
Stoich.:	A2B2C3D12E19 (1)
Weight, g/mol:	294.132805
ΔH_f, kcal/mol:	-89.12
Dipole, Da:	8.12
IP(EA), eV:	-8.28(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=C(SC(=S)N1)CC(=O)NCC(C)(C)C(=O)NC

DOS

IR

Vibrations