Geometry & MOs

Info

ID:	58518
PubChem CID:	24702224
Reduced:	O2N3C16H19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	290.04186
ΔH_f, kcal/mol:	-28.88
Dipole, Da:	0.91
IP(EA), eV:	-9.2(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-benzyl-4-bromo-1-N-methylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CN)OCC(=O)NCCC2=CC=CC=N2

DOS

IR

Vibrations