Geometry & MOs

Info

ID:	280774
PubChem CID:	103851213
Reduced:	SN4C12H18 (1)
Stoich.:	AB4C12D18 (1)
Weight, g/mol:	270.190755
ΔH_f, kcal/mol:	53.57
Dipole, Da:	2.23
IP(EA), eV:	-8.94(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-[(3,5-difluorophenyl)methyl]-2-N,2-N,4-trimethylpentane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)CNCCC2=CSC(=N2)C

DOS

IR

Vibrations