Geometry & MOs

Info

ID:	419647
PubChem CID:	135108635
Reduced:	N2O2C19H26 (1)
Stoich.:	A2B2C19D26 (1)
Weight, g/mol:	365.119798
ΔH_f, kcal/mol:	-49.17
Dipole, Da:	2.59
IP(EA), eV:	-8.83(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)CC3=CC4=CC=CC=C4O3)CO

DOS

IR

Vibrations