Geometry & MOs

Info

ID:	317496
PubChem CID:	126639393
Reduced:	O2N6C17H20 (1)
Stoich.:	A2B6C17D20 (1)
Weight, g/mol:	151.1361
ΔH_f, kcal/mol:	-3.28
Dipole, Da:	6.82
IP(EA), eV:	-8.78(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z,4Z)-3,4,6-trimethylhepta-2,4,6-trien-2-amine

Drug info:

PubChemData

Smile

CC(C)C(=O)NCC1=CC=C(C=C1)COC2=NC(=NC3=C2NC=N3)N

DOS

IR

Vibrations