Geometry & MOs

Info

ID:	269679
PubChem CID:	103618620
Reduced:	OSN4C10H12 (1)
Stoich.:	ABC4D10E12 (1)
Weight, g/mol:	290.126657
ΔH_f, kcal/mol:	21.32
Dipole, Da:	5.25
IP(EA), eV:	-9.21(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[methyl-(2-oxo-1,3-dihydroindole-5-carbonyl)amino]butanoate

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CCNC(=O)C2=CNN=C2

DOS

IR

Vibrations