Geometry & MOs

Info

ID:	448827
PubChem CID:	135293850
Reduced:	N2O3C31H40 (1)
Stoich.:	A2B3C31D40 (1)
Weight, g/mol:	244.121178
ΔH_f, kcal/mol:	-95.55
Dipole, Da:	6.13
IP(EA), eV:	-8.42(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-N-propylquinoline-2-carboxamide

Drug info:

PubChemData

Smile

CCCC(C(C)(C)C)N(C(=O)C1=CC(=CC(=C1)C)C)NC(=O)[C@@H](C)C2=CC3=C(C=C2)C=C(C=C3)OC

DOS

IR

Vibrations