Geometry & MOs

Info

ID:	393584
PubChem CID:	135021144
Reduced:	NO4C20H26 (1)
Stoich.:	AB4C20D26 (1)
Weight, g/mol:	370.196421
ΔH_f, kcal/mol:	-121.24
Dipole, Da:	2.97
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.814304
Charge, e:	0

Chem-info

IUPAC name:

[(3S)-3-[3-[tert-butyl(diphenyl)silyl]oxypropyl]oxiran-2-yl]methanol

Drug info:

PubChemData

Smile

CC1(OC[C@@H]2[C@@H](O1)CC[C@H](N2C(=O)OCC3=CC=CC=C3)CC=[CH+])C

DOS

IR

Vibrations