Geometry & MOs

Info

ID:	290445
PubChem CID:	104528549
Reduced:	OBr2N2H12C14 (1)
Stoich.:	AB2C2D12E14 (1)
Weight, g/mol:	221.189198
ΔH_f, kcal/mol:	-1.92
Dipole, Da:	0.99
IP(EA), eV:	-8.7(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-ethyl-5-N-methyl-5-N-pentylpyridine-3,5-diamine

Drug info:

PubChemData

Smile

CC(=O)C1=C(C=C(C=C1)NC2=C(C=C(C=C2)Br)Br)N

DOS

IR

Vibrations