Geometry & MOs

Info

ID:	14512
PubChem CID:	413479
Reduced:	NO4C15H21 (1)
Stoich.:	AB4C15D21 (1)
Weight, g/mol:	279.147058
ΔH_f, kcal/mol:	-150.99
Dipole, Da:	2.82
IP(EA), eV:	-8.64(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[3-[bis(2-hydroxyethyl)amino]phenyl]prop-2-enoate

Drug info:

PubChemData

Smile

CCOC(=O)C=CC1=CC(=CC=C1)N(CCO)CCO

DOS

IR

Vibrations