Geometry & MOs

Info

ID:	396079
PubChem CID:	135027360
Reduced:	N3O5C15H19 (1)
Stoich.:	A3B5C15D19 (1)
Weight, g/mol:	335.148121
ΔH_f, kcal/mol:	-133.17
Dipole, Da:	5.88
IP(EA), eV:	-9.12(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1,5-dimethyl-3-(nitromethyl)-2-oxoindol-3-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1(C2=CC=CC=C2N(C1=O)C)C[N+](=O)[O-]

DOS

IR

Vibrations