Geometry & MOs

Info

ID:	446978
PubChem CID:	135279248
Reduced:	NSO3C15H19 (1)
Stoich.:	ABC3D15E19 (1)
Weight, g/mol:	297.278013
ΔH_f, kcal/mol:	-69.72
Dipole, Da:	4.4
IP(EA), eV:	-8.77(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-[amino-[(1Z,3E)-3-tert-butylpenta-1,3-dienyl]amino]ethoxy]ethyl]-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CC(C)C(=O)C1=CC2=C(O1)C=CC(=C2)OCCNSC

DOS

IR

Vibrations