Geometry & MOs

Info

ID:	323188
PubChem CID:	126673325
Reduced:	N7O8C24H29 (1)
Stoich.:	A7B8C24D29 (1)
Weight, g/mol:	488.17274
ΔH_f, kcal/mol:	-106.35
Dipole, Da:	11.57
IP(EA), eV:	-9.23(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 5-[[5-[(5-tert-butyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]amino]-3,3-difluoropiperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(CCOC(=O)ON1C2=CC=CC=C2N=N1)OCC(C)(N)OCCOC(=O)ON3C4=CC=CC=C4N=N3

DOS

IR

Vibrations