Geometry & MOs

Info

ID:	251225
PubChem CID:	103102320
Reduced:	ClN3C10H16 (1)
Stoich.:	AB3C10D16 (1)
Weight, g/mol:	210.153227
ΔH_f, kcal/mol:	19.15
Dipole, Da:	2.89
IP(EA), eV:	-9.05(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-ethyl-N'-[(2-fluoro-3-methylphenyl)methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CCN)CC1=NC=C(C=C1)Cl

DOS

IR

Vibrations