Geometry & MOs

Info

ID:	440914
PubChem CID:	135232178
Reduced:	N4O4H26C29 (1)
Stoich.:	A4B4C26D29 (1)
Weight, g/mol:	465.168205
ΔH_f, kcal/mol:	-37.01
Dipole, Da:	7.61
IP(EA), eV:	-8.56(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[2-[6-[[(2-methylpropan-2-yl)oxycarbonylamino]oxymethyl]pyridin-3-yl]-1,3-thiazol-4-yl]carbamoyl]carbamate

Drug info:

PubChemData

Smile

C=C1CCC2=C(C=CN=C2N1)OC3=CC4=C(C=C3)OCC(C4)C5=NC=C(N5)C6=CC7=C(C=C6)OCCO7

DOS

IR

Vibrations