Geometry & MOs

Info

ID:	166114
PubChem CID:	74639735
Reduced:	N6O6C19H22 (1)
Stoich.:	A6B6C19D22 (1)
Weight, g/mol:	383.269853
ΔH_f, kcal/mol:	-168.06
Dipole, Da:	6.43
IP(EA), eV:	-8.73(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-[[2-(4-tert-butylphenoxy)acetyl]amino]-1-phenylethyl]-diethylazanium

Drug info:

PubChemData

Smile

CN1C2C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC(=O)NC3=CC4=C(C=C3)OCCCO4

DOS

IR

Vibrations