Geometry & MOs

Info

ID:	391573
PubChem CID:	135006608
Reduced:	ClO2N3C15H16 (1)
Stoich.:	AB2C3D15E16 (1)
Weight, g/mol:	310.21709
ΔH_f, kcal/mol:	-51.19
Dipole, Da:	3.13
IP(EA), eV:	-9.11(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(2-cyclopropyl-4,5-dimethylcyclohexa-1,4-dien-1-yl)-(4-methoxyphenyl)methylidene]-dimethylazanium

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C2=NC(=NC=C2)Cl

DOS

IR

Vibrations