Geometry & MOs

Info

ID:	76360
PubChem CID:	48424829
Reduced:	NO2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	303.183444
ΔH_f, kcal/mol:	-132.19
Dipole, Da:	4.94
IP(EA), eV:	-9.38(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-(2-methyl-6-phenylmorpholin-4-yl)propan-1-one

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C2=CC=CC=C2)C(=O)C(CC3=CC=CC=C3)NC(=O)OC

DOS

IR

Vibrations