Geometry & MOs

Info

ID:	189111
PubChem CID:	77818947
Reduced:	NO5C16H29 (1)
Stoich.:	AB5C16D29 (1)
Weight, g/mol:	615.190291
ΔH_f, kcal/mol:	-266.55
Dipole, Da:	3.27
IP(EA), eV:	-9.6(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(2,6-dichlorobenzoyl)amino]-3-[4-[3-[6-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2,3-dihydropyridin-2-yl]prop-2-enoxy]phenyl]propanoate

Drug info:

PubChemData

Smile

CCCCOC(=O)NC(CC1CC(OC(C1)C)C)C(=O)OC

DOS

IR

Vibrations