Geometry & MOs

Info

ID:	305620
PubChem CID:	124962682
Reduced:	O2N4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	279.169525
ΔH_f, kcal/mol:	-19.26
Dipole, Da:	1.58
IP(EA), eV:	-8.7(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N,N,1-trimethyl-4-(1-methylpyrazole-3-carbonyl)piperazine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CC(=O)N2CCC[C@H]2C3=CC(=NC=C3)NC

DOS

IR

Vibrations