Geometry & MOs

Info

ID:	151158
PubChem CID:	53790858
Reduced:	N4C27H34 (1)
Stoich.:	A4B27C34 (1)
Weight, g/mol:	361.118832
ΔH_f, kcal/mol:	65.82
Dipole, Da:	1.45
IP(EA), eV:	-7.92(0.26)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(2-methoxy-11-oxo-5H-pyrido[2,1-b]quinazolin-10-ium-8-yl)methyl benzoate

Drug info:

PubChemData

Smile

CCCNC1=C(C=C(C=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)N

DOS

IR

Vibrations