Geometry & MOs

Info

ID:	278876
PubChem CID:	103839387
Reduced:	FN2O3C14H15 (1)
Stoich.:	AB2C3D14E15 (1)
Weight, g/mol:	224.188863
ΔH_f, kcal/mol:	-37.07
Dipole, Da:	4.98
IP(EA), eV:	-10.14(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(tert-butylamino)-N-[(1-cyclopropylcyclopropyl)methyl]acetamide

Drug info:

PubChemData

Smile

C1CC1C2(CC2)CNC(=O)C3=C(C=CC(=C3)F)[N+](=O)[O-]

DOS

IR

Vibrations