Geometry & MOs

Info

ID:	448638
PubChem CID:	135292409
Reduced:	SN3O6C19H23 (1)
Stoich.:	AB3C6D19E23 (1)
Weight, g/mol:	234.209599
ΔH_f, kcal/mol:	-172.96
Dipole, Da:	7.69
IP(EA), eV:	-9.59(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,5-dimethyl-N-[(2E,4E)-4-(methylideneamino)hexa-2,4-dien-3-yl]hex-5-en-1-amine

Drug info:

PubChemData

Smile

C1CC(C1)(C2=C(N=C(C=C2)C(=O)NC3(CS(=O)(=O)C3)CC(=O)N)OC=C4CC4)O

DOS

IR

Vibrations