Geometry & MOs

Info

ID:	200260
PubChem CID:	79374602
Reduced:	ON3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	244.121178
ΔH_f, kcal/mol:	-20.23
Dipole, Da:	2.97
IP(EA), eV:	-8.24(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-2-(3-methylpyrazol-1-yl)-2,3-dihydro-1H-inden-1-ol

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2CC3=C(C2N)C=C(C=C3)OC

DOS

IR

Vibrations