Geometry & MOs

Info

ID:	82862
PubChem CID:	49856703
Reduced:	NC4H5 (5)
Stoich.:	AB4C5 (5)
Weight, g/mol:	581.263819
ΔH_f, kcal/mol:	86.17
Dipole, Da:	4.36
IP(EA), eV:	-8.16(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-[4-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)dibenzofuran-1-yl]propanamide

Drug info:

PubChemData

Smile

C[C@@H]1CCN(C[C@@H]1N(C)C2=NC=NC3=C2C=CN3)CC4=CC=CC=C4

DOS

IR

Vibrations