Geometry & MOs

Info

ID:	441110
PubChem CID:	135233147
Reduced:	F2O2N3C23H25 (1)
Stoich.:	A2B2C3D23E25 (1)
Weight, g/mol:	327.2926
ΔH_f, kcal/mol:	-35.71
Dipole, Da:	3.28
IP(EA), eV:	-8.96(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E,6E,8E)-N-but-1-en-2-yl-5,8,9-trimethyl-10-methylidene-6-prop-2-enyldodeca-1,6,8-trien-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)N=O)C2=NOC(=N2)C3=C(C=CC=C3F)CF

DOS

IR

Vibrations