Geometry & MOs

Info

ID:	194422
PubChem CID:	78533911
Reduced:	NSO3C14H19 (1)
Stoich.:	ABC3D14E19 (1)
Weight, g/mol:	378.109483
ΔH_f, kcal/mol:	-128.72
Dipole, Da:	5.64
IP(EA), eV:	-9.3(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(tert-butylcarbamoylamino)-2-oxoethyl] 3-(2-chloroimidazo[1,2-a]pyridin-3-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CCC1CCC2=C(C1)C=C(S2)C(=O)OCC(=O)NC

DOS

IR

Vibrations