Geometry & MOs

Info

ID:	435157
PubChem CID:	135182441
Reduced:	OC3H5 (4)
Stoich.:	AB3C5 (4)
Weight, g/mol:	399.11881
ΔH_f, kcal/mol:	-190.15
Dipole, Da:	6.22
IP(EA), eV:	-10.18(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[[4-(2-amino-2-oxoethanimidoyl)-2-(trifluoromethoxymethylamino)-4,5-dihydro-1,3-thiazol-5-yl]amino]acetate

Drug info:

PubChemData

Smile

CCC1([C@H]2CC[C@@H](C1(C)OCC)O2)C(=O)O

DOS

IR

Vibrations