Geometry & MOs

Info

ID:	363222
PubChem CID:	127310362
Reduced:	ON2C9H15 (2)
Stoich.:	AB2C9D15 (2)
Weight, g/mol:	389.20386
ΔH_f, kcal/mol:	-76.6
Dipole, Da:	5.81
IP(EA), eV:	-8.94(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methylpyrazol-1-yl)methyl]-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)NCCC3CCCCC3

DOS

IR

Vibrations