Geometry & MOs

Info

ID:	216460
PubChem CID:	85086271
Reduced:	NO6C12H17 (1)
Stoich.:	AB6C12D17 (1)
Weight, g/mol:	271.085795
ΔH_f, kcal/mol:	-157.24
Dipole, Da:	3.59
IP(EA), eV:	-9.64(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-4-quinolin-3-ylbuta-1,3-diene-1,1,3-tricarbonitrile

Drug info:

PubChemData

Smile

COC1(C2C(O2)C(C=C1NC(=O)OCC=C)O)OC

DOS

IR

Vibrations