Geometry & MOs

Info

ID:	270741
PubChem CID:	103637906
Reduced:	N2F3C15H21 (1)
Stoich.:	A2B3C15D21 (1)
Weight, g/mol:	248.188863
ΔH_f, kcal/mol:	-123.74
Dipole, Da:	3.14
IP(EA), eV:	-8.58(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-cyclopropyl-N'-ethyl-N-[(3-methoxyphenyl)methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CCNCC1=CC=CC=C1C(F)(F)F)C2CC2

DOS

IR

Vibrations