Geometry & MOs

Info

ID:	224403
PubChem CID:	85342501
Reduced:	ClSO2N3H16C21 (1)
Stoich.:	ABC2D3E16F21 (1)
Weight, g/mol:	411.207714
ΔH_f, kcal/mol:	52.88
Dipole, Da:	1.76
IP(EA), eV:	-9.16(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[5-[1-[dimethyl(propan-2-yl)silyl]oxyethyl]-2-hydroxy-4-methoxyoxolan-3-yl]carbamate

Drug info:

PubChemData

Smile

CC1=NOC(=C1N2C(=O)CSC2=NC3=CC=CC=C3)C=CC4=CC=C(C=C4)Cl

DOS

IR

Vibrations