Geometry & MOs

Info

ID:	84092
PubChem CID:	49864093
Reduced:	PN2O9C19H29 (1)
Stoich.:	AB2C9D19E29 (1)
Weight, g/mol:	468.123215
ΔH_f, kcal/mol:	-420.14
Dipole, Da:	6.06
IP(EA), eV:	-9.26(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-(aminomethyl)-5-(2,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyrimidin-2-yl]-2-[(6-methylpyridin-2-yl)methylamino]ethanone

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H](C)NP(=O)(OC[C@@H]1[C@@H](OC(O1)(C)C)C(=O)NO)OC2=CC=C(C=C2)C

DOS

IR

Vibrations