Geometry & MOs

Info

ID:	441157
PubChem CID:	135233361
Reduced:	ON6C24H38 (1)
Stoich.:	AB6C24D38 (1)
Weight, g/mol:	299.2613
ΔH_f, kcal/mol:	-42.27
Dipole, Da:	2.31
IP(EA), eV:	-7.98(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-5-(4-butan-2-yl-3-methyl-5-methylidenecyclohexa-1,3-dien-1-yl)-N-prop-1-en-2-ylhex-1-en-1-amine

Drug info:

PubChemData

Smile

CC1=CN=C(N1)C(=O)NC2CC(CCC2(C)C)C3=NC(=C(C=C3)NCC(C)(C)C)NC

DOS

IR

Vibrations