Geometry & MOs

Info

ID:	423648
PubChem CID:	135119902
Reduced:	N3O3C17H19 (1)
Stoich.:	A3B3C17D19 (1)
Weight, g/mol:	344.20124
ΔH_f, kcal/mol:	-63.97
Dipole, Da:	3.67
IP(EA), eV:	-9.41(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-1-(2-fluorophenyl)-N-[(5-methyl-1H-imidazol-4-yl)methyl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CN1C=CC=C1C(=O)C(=O)N2C[C@H]([C@@H](C2)O)CC3=CC=CC=N3

DOS

IR

Vibrations