Geometry & MOs

Info

ID:	340362
PubChem CID:	127262373
Reduced:	NPO6C9H18 (1)
Stoich.:	ABC6D9E18 (1)
Weight, g/mol:	267.077658
ΔH_f, kcal/mol:	-357.69
Dipole, Da:	6.53
IP(EA), eV:	-10.51(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(aminomethoxysulfonyloxy)cyclohexyl]acetic acid

Drug info:

PubChemData

Smile

C1CCC(CC1)(CC(=O)O)OP(=O)(O)OCN

DOS

IR

Vibrations