Geometry & MOs

Info

ID:	324673
PubChem CID:	126678114
Reduced:	N2O3C23H28 (1)
Stoich.:	A2B3C23D28 (1)
Weight, g/mol:	263.152144
ΔH_f, kcal/mol:	-82.32
Dipole, Da:	3.21
IP(EA), eV:	-8.67(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (Z)-3-[(4-methoxyphenyl)methylamino]pent-2-enoate

Drug info:

PubChemData

Smile

CC[C@@H]1[C@H]([C@@H](CCN1)C2=CC=C(C=C2)OC)COC3=CC4=C(CNC4=O)C=C3

DOS

IR

Vibrations