Geometry & MOs

Info

ID:	427652
PubChem CID:	135160991
Reduced:	O2N7C29H29 (1)
Stoich.:	A2B7C29D29 (1)
Weight, g/mol:	156.162649
ΔH_f, kcal/mol:	95.24
Dipole, Da:	2.45
IP(EA), eV:	-8.47(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-N,4-N,3-trimethylhex-2-ene-2,4-diamine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=C)CN(C2=NC3=NC(=CN=C3C=C2)C4=CN(N=C4)C)C5=CC(=CC(=C5)OC)OC

DOS

IR

Vibrations