Geometry & MOs

Info

ID:	343432
PubChem CID:	127266605
Reduced:	N3O3C16H17 (1)
Stoich.:	A3B3C16D17 (1)
Weight, g/mol:	327.119461
ΔH_f, kcal/mol:	-52.88
Dipole, Da:	4.0
IP(EA), eV:	-9.29(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-4-(1H-imidazol-5-yl)-N-(3,3,3-trifluoro-2-hydroxypropyl)benzamide

Drug info:

PubChemData

Smile

COC(=O)C1(CC1)CNC(=O)C2=CC=C(C=C2)C3=CN=CN3

DOS

IR

Vibrations