Geometry & MOs

Info

ID:	234582
PubChem CID:	92303110
Reduced:	SF2O2N3H17C19 (1)
Stoich.:	AB2C2D3E17F19 (1)
Weight, g/mol:	292.178693
ΔH_f, kcal/mol:	-113.62
Dipole, Da:	1.86
IP(EA), eV:	-9.34(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-(3-methoxybenzoyl)-N'-[(2S)-3-methylbutan-2-yl]carbamimidate

Drug info:

PubChemData

Smile

CCN1C(=O)C[C@@H](SC1=NC2=CC(=CC=C2)F)C(=O)NC3=CC=CC=C3F

DOS

IR

Vibrations