Geometry & MOs

Info

ID:	79620
PubChem CID:	49829739
Reduced:	N2O3C25H32 (1)
Stoich.:	A2B3C25D32 (1)
Weight, g/mol:	411.239616
ΔH_f, kcal/mol:	-123.34
Dipole, Da:	2.32
IP(EA), eV:	-8.9(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl]-methyl-[(2-morpholin-4-ylphenyl)methyl]azanium

Drug info:

PubChemData

Smile

COCC1CCCN(C1)C(=O)CC[C@@]2(CCC(=O)N2)CC3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations