Geometry & MOs

Info

ID:	206547
PubChem CID:	80267536
Reduced:	FON3C14H14 (1)
Stoich.:	ABC3D14E14 (1)
Weight, g/mol:	247.204848
ΔH_f, kcal/mol:	-39.65
Dipole, Da:	4.35
IP(EA), eV:	-9.68(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-N-ethyl-N'-methyl-N'-[(6-methylpyridin-2-yl)methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)NCC2=NC=C(N=C2)C)F

DOS

IR

Vibrations