Geometry & MOs

Info

ID:	255165
PubChem CID:	103130469
Reduced:	O2N3C11H17 (1)
Stoich.:	A2B3C11D17 (1)
Weight, g/mol:	212.061949
ΔH_f, kcal/mol:	-31.92
Dipole, Da:	6.8
IP(EA), eV:	-8.6(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methylpyrazol-3-yl)-(1,4-oxathian-2-yl)methanone

Drug info:

PubChemData

Smile

CCN1CCOC(C1)C(=O)C2=NN(C=C2)C

DOS

IR

Vibrations