Geometry & MOs

Info

ID:	290860
PubChem CID:	111365499
Reduced:	ON4C18H28 (1)
Stoich.:	AB4C18D28 (1)
Weight, g/mol:	340.29506
ΔH_f, kcal/mol:	-15.48
Dipole, Da:	1.76
IP(EA), eV:	-8.72(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[ethylamino-[[3-(4-ethylpiperazin-1-yl)-2-methylpropyl]amino]methylidene]amino]-N,N-dimethylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)CN=C(NCC(=C)C)NCC(=O)N(C)C)C

DOS

IR

Vibrations