Geometry & MOs

Info

ID:	188043
PubChem CID:	77659172
Reduced:	ON2C5H8 (3)
Stoich.:	AB2C5D8 (3)
Weight, g/mol:	539.22024
ΔH_f, kcal/mol:	-53.38
Dipole, Da:	9.34
IP(EA), eV:	-9.93(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[8-(3,4-dihydro-2H-chromen-4-ylamino)-2-methyl-6-(morpholine-4-carbonyl)imidazo[1,2-a]pyridin-3-yl]amino]-4-methylsulfanylbutanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCCCCN1C=NC2C1=NN=NC2=O

DOS

IR

Vibrations