Geometry & MOs

Info

ID:	25684
PubChem CID:	628695
Reduced:	O5C22H30 (1)
Stoich.:	A5B22C30 (1)
Weight, g/mol:	316.088164
ΔH_f, kcal/mol:	-259.05
Dipole, Da:	6.23
IP(EA), eV:	-10.26(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(1,3-dioxolan-2-yl)phenyl]sulfanyl-N'-hydroxybenzenecarboximidamide

Drug info:

PubChemData

Smile

CC(=O)OC1CCC2C1(CCC3C2CCC45C3(CCC(=O)C4)COC5=O)C

DOS

IR

Vibrations