Geometry & MOs

Info

ID:	69343
PubChem CID:	46530760
Reduced:	O2N7C18H23 (1)
Stoich.:	A2B7C18D23 (1)
Weight, g/mol:	369.194008
ΔH_f, kcal/mol:	17.09
Dipole, Da:	5.69
IP(EA), eV:	-9.34(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[2-[[2-(2-tert-butylphenoxy)acetyl]amino]ethyl]benzoate

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)N4C=NN=N4

DOS

IR

Vibrations