Geometry & MOs

Info

ID:	22709
PubChem CID:	598395
Reduced:	NO2C16H23 (1)
Stoich.:	AB2C16D23 (1)
Weight, g/mol:	261.172879
ΔH_f, kcal/mol:	-68.83
Dipole, Da:	0.64
IP(EA), eV:	-9.28(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(2-phenylethylamino)methyl]pent-4-enoate

Drug info:

PubChemData

Smile

CCOC(=O)C(CC=C)CNCCC1=CC=CC=C1

DOS

IR

Vibrations