Geometry & MOs

Info

ID:	432504
PubChem CID:	135172637
Reduced:	SO2N4C22H26 (1)
Stoich.:	AB2C4D22E26 (1)
Weight, g/mol:	396.179755
ΔH_f, kcal/mol:	-27.16
Dipole, Da:	2.9
IP(EA), eV:	-8.4(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-3-[2-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]furo[3,2-d]pyrimidin-4-yl]-4-propan-2-yl-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)[C@H](C)NC2=NC3=C(C(=N2)N4[C@H](COC4=O)C(C)C)SC=C3

DOS

IR

Vibrations