Geometry & MOs

Info

ID:	340539
PubChem CID:	127262550
Reduced:	N2O2C11H12 (1)
Stoich.:	A2B2C11D12 (1)
Weight, g/mol:	204.089878
ΔH_f, kcal/mol:	-44.43
Dipole, Da:	4.67
IP(EA), eV:	-9.21(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 1H-pyrrolo[3,2-c]pyridine-6-carboxylate

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1=NC=C2C(=C1)C=CN2

DOS

IR

Vibrations