Geometry & MOs

Info

ID:	290010
PubChem CID:	104397403
Reduced:	FN2C15H25 (1)
Stoich.:	AB2C15D25 (1)
Weight, g/mol:	318.07653
ΔH_f, kcal/mol:	-57.29
Dipole, Da:	1.45
IP(EA), eV:	-8.78(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[(5-bromo-4-methylthiophen-2-yl)methyl]-1-N-(2-methylpropyl)propane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)CNC(C)CNCC(C)C)F

DOS

IR

Vibrations