Geometry & MOs

Info

ID:	176672
PubChem CID:	76081608
Reduced:	B2P4C11O19H24 (1)
Stoich.:	A2B4C11D19E24 (1)
Weight, g/mol:	357.168856
ΔH_f, kcal/mol:	-983.02
Dipole, Da:	5.33
IP(EA), eV:	-8.88(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[4-[3-(hydroxymethyl)pyrrol-1-yl]-3,5-dimethylphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

Drug info:

PubChemData

Smile

[B]C1C(C(C(O1)COP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OCC(C(CO)O)OC([B])C)O)O

DOS

IR

Vibrations