Geometry & MOs

Info

ID:	290731
PubChem CID:	109883247
Reduced:	ON2C9H16 (2)
Stoich.:	AB2C9D16 (2)
Weight, g/mol:	316.139862
ΔH_f, kcal/mol:	-100.35
Dipole, Da:	6.4
IP(EA), eV:	-8.95(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[[4-hydroxy-4-(trifluoromethyl)piperidin-1-yl]methyl]phenyl]acetamide

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)C(C)N1CCC(CC1)C(C2=NC=CN2C)O

DOS

IR

Vibrations