Geometry & MOs

Info

ID:	437262
PubChem CID:	135220347
Reduced:	O3N7C27H35 (1)
Stoich.:	A3B7C27D35 (1)
Weight, g/mol:	181.18305
ΔH_f, kcal/mol:	-83.72
Dipole, Da:	3.16
IP(EA), eV:	-8.17(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z,6E)-5-ethyl-7-methylnona-3,6-dien-3-amine

Drug info:

PubChemData

Smile

CC1CC(CN(C1)C2=NC3=C(C(=O)NN=C3)C(=N2)NC4=CC=C(C=C4)N5CCC(CC5)(C)CC(=O)O)C

DOS

IR

Vibrations