Geometry & MOs

Info

ID:	363812
PubChem CID:	127313469
Reduced:	O2N3C19H31 (1)
Stoich.:	A2B3C19D31 (1)
Weight, g/mol:	359.232125
ΔH_f, kcal/mol:	-96.45
Dipole, Da:	6.39
IP(EA), eV:	-8.7(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-5-cyclopropyl-1-methylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC(=CC1)CC(=O)NCCN2CCN(CC2)C(=O)C3CCC3

DOS

IR

Vibrations