Geometry & MOs

Info

ID:	285704
PubChem CID:	104120624
Reduced:	BrN3C10H16 (1)
Stoich.:	AB3C10D16 (1)
Weight, g/mol:	179.142248
ΔH_f, kcal/mol:	23.12
Dipole, Da:	3.78
IP(EA), eV:	-8.64(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-4-(propylaminomethyl)pyridin-2-amine

Drug info:

PubChemData

Smile

CCCNCC1=C(N=CC(=C1)Br)NC

DOS

IR

Vibrations