Geometry & MOs

Info

ID:	75134
PubChem CID:	48423071
Reduced:	NOC10H16 (2)
Stoich.:	ABC10D16 (2)
Weight, g/mol:	413.229012
ΔH_f, kcal/mol:	-74.29
Dipole, Da:	2.2
IP(EA), eV:	-8.49(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]propanamide

Drug info:

PubChemData

Smile

CCN(CC)C(CC1=CC=CC=C1)CNC(=O)C(C)OCC2CC2

DOS

IR

Vibrations