Geometry & MOs

Info

ID:	448153
PubChem CID:	135288872
Reduced:	N2O4C7H18 (1)
Stoich.:	A2B4C7D18 (1)
Weight, g/mol:	383.185844
ΔH_f, kcal/mol:	-138.56
Dipole, Da:	5.26
IP(EA), eV:	-9.7(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-4-piperidin-1-yl-2-[5-(1H-pyrazol-4-yl)-1,2-dihydroindazol-3-ylidene]pyrrolo[3,2-c]pyridine

Drug info:

PubChemData

Smile

CCN(CC)C(=O)N(O)O.COC

DOS

IR

Vibrations