Geometry & MOs

Info

ID:	294209
PubChem CID:	117435288
Reduced:	N3O4H11C13 (1)
Stoich.:	A3B4C11D13 (1)
Weight, g/mol:	273.147727
ΔH_f, kcal/mol:	-49.96
Dipole, Da:	4.66
IP(EA), eV:	-9.16(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4,7-dimethoxy-2,3-dihydro-1H-inden-5-yl)-2-methylpyrazol-3-amine

Drug info:

PubChemData

Smile

C1CN(NC1=O)C2=CC=C(C=C2)C3=NOC(=C3)C(=O)O

DOS

IR

Vibrations