Geometry & MOs

Info

ID:	331838
PubChem CID:	127250124
Reduced:	NOC6H7 (4)
Stoich.:	ABC6D7 (4)
Weight, g/mol:	434.231791
ΔH_f, kcal/mol:	-70.7
Dipole, Da:	3.55
IP(EA), eV:	-8.78(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(dimethylamino)methyl]-5-methyl-1,2-oxazol-3-yl]-[2-[6-[(2-methylphenyl)methyl]pyridin-2-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC2=NC(=CC=C2)C3CN(CCO3)C(=O)CCC4=NC(=NO4)C

DOS

IR

Vibrations