Geometry & MOs

Info

ID:	74976
PubChem CID:	48422778
Reduced:	N2O4C17H24 (1)
Stoich.:	A2B4C17D24 (1)
Weight, g/mol:	241.167794
ΔH_f, kcal/mol:	-166.88
Dipole, Da:	2.03
IP(EA), eV:	-9.3(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-(2-ethylmorpholin-4-yl)propan-1-one

Drug info:

PubChemData

Smile

CCC1CN(CCO1)C(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations