Geometry & MOs

Info

ID:	286233
PubChem CID:	104163345
Reduced:	N2O3C16H20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	-113.66
Dipole, Da:	9.91
IP(EA), eV:	-9.03(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[ethyl(propyl)carbamoyl]-2,3-dihydroindole-6-carboxylic acid

Drug info:

PubChemData

Smile

CN(C1CCCC1)C(=O)N2CCC3=C2C=C(C=C3)C(=O)O

DOS

IR

Vibrations