Geometry & MOs

Info

ID:	357452
PubChem CID:	127294085
Reduced:	NO3C9H11 (2)
Stoich.:	AB3C9D11 (2)
Weight, g/mol:	275.126991
ΔH_f, kcal/mol:	-222.84
Dipole, Da:	2.66
IP(EA), eV:	-8.45(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dioxan-2-ylmethyl)-2-indazol-1-ylacetamide

Drug info:

PubChemData

Smile

C1CN(C(=O)C1C(=O)NCC2COCCO2)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations