Geometry & MOs

Info

ID:	36789
PubChem CID:	8012709
Reduced:	N2O3H16C19 (1)
Stoich.:	A2B3C16D19 (1)
Weight, g/mol:	368.14601
ΔH_f, kcal/mol:	-30.87
Dipole, Da:	3.19
IP(EA), eV:	-9.0(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(furan-2-ylmethyl)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CN=C(C=C1)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)C(=O)C

DOS

IR

Vibrations