Geometry & MOs

Info

ID:	290864
PubChem CID:	111367274
Reduced:	IN5C19H30 (1)
Stoich.:	AB5C19D30 (1)
Weight, g/mol:	417.27399
ΔH_f, kcal/mol:	60.52
Dipole, Da:	4.28
IP(EA), eV:	-8.85(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N'-[2-hydroxy-2-(4-methylphenyl)ethyl]-4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carboximidamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)CNC(=NC)N(C)CC2=CN(N=C2)C.I

DOS

IR

Vibrations