Geometry & MOs

Info

ID:	297006
PubChem CID:	117605618
Reduced:	NC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	236.079707
ΔH_f, kcal/mol:	15.89
Dipole, Da:	0.74
IP(EA), eV:	-7.68(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-7-nitro-2,3-dihydro-1H-indole-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(=C/C=C/N1CCNCC1)C

DOS

IR

Vibrations