Geometry & MOs

Info

ID:	145406
PubChem CID:	53518127
Reduced:	NO2C9H10 (2)
Stoich.:	AB2C9D10 (2)
Weight, g/mol:	333.205242
ΔH_f, kcal/mol:	-95.72
Dipole, Da:	10.78
IP(EA), eV:	-9.4(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methyl-4-morpholin-4-ylanilino)-1-morpholin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

CC(C)(C)N1C=C(C=N1)/C=C/C(=O)C2=CC(=CC=C2)OCC(=O)O

DOS

IR

Vibrations