Geometry & MOs

Info

ID:	246128
PubChem CID:	103045405
Reduced:	N2O2H16C17 (1)
Stoich.:	A2B2C16D17 (1)
Weight, g/mol:	272.073182
ΔH_f, kcal/mol:	-18.0
Dipole, Da:	3.05
IP(EA), eV:	-9.32(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-4-(quinolin-5-yloxymethyl)thiadiazol-5-amine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=C1CO)OC2=CC=CC3=C2C=CC=N3)C

DOS

IR

Vibrations