Geometry & MOs

Info

ID:	215448
PubChem CID:	85084747
Reduced:	N9O9C47H89 (1)
Stoich.:	A9B9C47D89 (1)
Weight, g/mol:	924.356836
ΔH_f, kcal/mol:	-537.01
Dipole, Da:	7.75
IP(EA), eV:	-9.4(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,4,5-tribenzoyloxy-6-(3,5-diacetyloxy-2-octoxyoxan-4-yl)oxyoxan-2-yl]methyl benzoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC(=O)NC(CO)C(=O)NC(CC(C)C)C(=O)NC(C(C)CC)C(=O)NCC(=O)NC(CCCN=C(N)N)C(=O)NC(CC(C)C)C(=O)O

DOS

IR

Vibrations