Geometry & MOs

Info

ID:	177720
PubChem CID:	76220953
Reduced:	N3C11H19 (1)
Stoich.:	A3B11C19 (1)
Weight, g/mol:	184.101191
ΔH_f, kcal/mol:	7.02
Dipole, Da:	5.42
IP(EA), eV:	-8.2(1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,2-diaminoethyl)-4-fluoro-6-methylphenol

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C)C)C2CNCCN2

DOS

IR

Vibrations