Geometry & MOs

Info

ID:	284575
PubChem CID:	104053350
Reduced:	FNOC18H22 (1)
Stoich.:	ABCD18E22 (1)
Weight, g/mol:	213.093583
ΔH_f, kcal/mol:	-65.43
Dipole, Da:	2.95
IP(EA), eV:	-8.46(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-amino-1,3-thiazol-5-yl)-1,5-dimethylpyrrolidin-3-ol

Drug info:

PubChemData

Smile

CCNCC1=CC(=C(C=C1)C2=C(C=C(C(=C2)C)OC)C)F

DOS

IR

Vibrations