Geometry & MOs

Info

ID:	348905
PubChem CID:	127274630
Reduced:	SN3O4C16H19 (1)
Stoich.:	AB3C4D16E19 (1)
Weight, g/mol:	392.115441
ΔH_f, kcal/mol:	-100.63
Dipole, Da:	8.06
IP(EA), eV:	-8.05(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1-methylpyrazol-3-yl)sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CN1C=CC(=N1)S(=O)(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4

DOS

IR

Vibrations