Geometry & MOs

Info

ID:	362399
PubChem CID:	127307744
Reduced:	ON5C15H21 (1)
Stoich.:	AB5C15D21 (1)
Weight, g/mol:	365.185175
ΔH_f, kcal/mol:	1.67
Dipole, Da:	3.49
IP(EA), eV:	-9.05(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]cinnolin-4-one

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C2CCCN2C(=O)C3=CN=C(N3)C

DOS

IR

Vibrations