Geometry & MOs

Info

ID:	134581
PubChem CID:	51716228
Reduced:	N2O5C23H30 (1)
Stoich.:	A2B5C23D30 (1)
Weight, g/mol:	397.249118
ΔH_f, kcal/mol:	-160.07
Dipole, Da:	3.29
IP(EA), eV:	-8.66(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

diethyl-[(1S)-2-[[2-(2-methoxy-4-prop-2-enylphenoxy)acetyl]amino]-1-phenylethyl]azanium

Drug info:

PubChemData

Smile

CC[C@H](C1=CC=CC=C1)C(=O)NNC(=O)C2=CC(=C(C(=C2)OCC)OCC)OCC

DOS

IR

Vibrations