Geometry & MOs

Info

ID:	24663
PubChem CID:	612021
Reduced:	NO3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	271.120843
ΔH_f, kcal/mol:	-112.18
Dipole, Da:	1.72
IP(EA), eV:	-9.08(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 1-oxo-2,3-dihydropyrrolo[1,2-a]indole-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C1=C2CCC(=O)N2C3=CC=CC=C31

DOS

IR

Vibrations