Geometry & MOs

Info

ID:	253290
PubChem CID:	103117404
Reduced:	N3O5H7C9 (1)
Stoich.:	A3B5C7D9 (1)
Weight, g/mol:	270.148061
ΔH_f, kcal/mol:	-112.25
Dipole, Da:	11.71
IP(EA), eV:	-10.19(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-1-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C2=NC(=C(O2)C(=O)O)C(=O)O

DOS

IR

Vibrations