Geometry & MOs

Info

ID:	177641
PubChem CID:	76207786
Reduced:	O4C15H18 (1)
Stoich.:	A4B15C18 (1)
Weight, g/mol:	263.126991
ΔH_f, kcal/mol:	-124.71
Dipole, Da:	7.31
IP(EA), eV:	-9.13(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(N'-hydroxycarbamimidoyl)phenyl]oxane-2-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)COC2CCC2)C=CC(=O)O

DOS

IR

Vibrations