Geometry & MOs

Info

ID:	3852
PubChem CID:	10304
Reduced:	NOC14H20 (2)
Stoich.:	ABC14D20 (2)
Weight, g/mol:	436.308979
ΔH_f, kcal/mol:	-47.81
Dipole, Da:	1.16
IP(EA), eV:	-8.2(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(diethylaminomethyl)-4-[3-(diethylaminomethyl)-4-hydroxy-5-prop-2-enylphenyl]-6-prop-2-enylphenol

Drug info:

PubChemData

Smile

CCN(CC)CC1=CC(=CC(=C1O)CC=C)C2=CC(=C(C(=C2)CN(CC)CC)O)CC=C

DOS

IR

Vibrations