Geometry & MOs

Info

ID:	232543
PubChem CID:	87576391
Reduced:	PN5O24C63H78 (1)
Stoich.:	AB5C24D63E78 (1)
Weight, g/mol:	253.95427
ΔH_f, kcal/mol:	-988.65
Dipole, Da:	11.22
IP(EA), eV:	-8.71(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

Smile

CCOC(=O)C(COC(=O)C)(COP(=O)(OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)NC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=C(C=C6)OC)OC(=O)CCC(=O)C)OCOC(=O)C(C)(C)C)OCC(COC(=O)C)(C(=O)OCC)C(=O)OCC)C(=O)OCC

DOS

IR

Vibrations