Geometry & MOs

Info

ID:	145278
PubChem CID:	53491827
Reduced:	ClO2N4C23H23 (1)
Stoich.:	AB2C4D23E23 (1)
Weight, g/mol:	549.269967
ΔH_f, kcal/mol:	-28.17
Dipole, Da:	10.75
IP(EA), eV:	-9.32(-1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-acetamido-N-[8-[3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propoxy]-7-methoxy-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCC1=CC2=C(C=C1C)N=C3C(=O)NC(=O)N=C3N2CCCC4=CC=C(C=C4)Cl

DOS

IR

Vibrations