Geometry & MOs

Info

ID:	228677
PubChem CID:	87565527
Reduced:	INO6C17H30 (1)
Stoich.:	ABC6D17E30 (1)
Weight, g/mol:	658.116682
ΔH_f, kcal/mol:	-304.82
Dipole, Da:	2.72
IP(EA), eV:	-9.96(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	-4

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC(C)[C@@H](C(=O)OCC(C)(C)C(=O)OCI)NC(=O)OC(C)(C)C

DOS

IR

Vibrations