Geometry & MOs

Info

ID:	423469
PubChem CID:	135119558
Reduced:	ClFON2C14H14 (1)
Stoich.:	ABCD2E14F14 (1)
Weight, g/mol:	387.263425
ΔH_f, kcal/mol:	-67.05
Dipole, Da:	4.05
IP(EA), eV:	-8.78(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-5-ethyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-4-(pyrrolidin-1-ylmethyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NC2=C1C=CC(=C2)Cl)N3C[C@H]([C@@H](C3)F)O

DOS

IR

Vibrations