Geometry & MOs

Info

ID:	407657
PubChem CID:	135080407
Reduced:	N2O3C10H10 (1)
Stoich.:	A2B3C10D10 (1)
Weight, g/mol:	204.089878
ΔH_f, kcal/mol:	-72.65
Dipole, Da:	11.28
IP(EA), eV:	-8.25(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1H-pyrrolo[2,3-b]pyridin-2-yl)butanoic acid

Drug info:

PubChemData

Smile

CC1=C2C=C(NC=C2NC(=O)C1=O)OC

DOS

IR

Vibrations