Geometry & MOs

Info

ID:	247965
PubChem CID:	103077779
Reduced:	O2N3C13H27 (1)
Stoich.:	A2B3C13D27 (1)
Weight, g/mol:	228.137497
ΔH_f, kcal/mol:	-109.13
Dipole, Da:	3.89
IP(EA), eV:	-8.9(1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-dihydro-2H-quinolin-1-yl)-1-methylpyrazol-4-amine

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)NCCOCCN(C)C

DOS

IR

Vibrations