Geometry & MOs

Info

ID:	74988
PubChem CID:	48422824
Reduced:	NO2C15H27 (1)
Stoich.:	AB2C15D27 (1)
Weight, g/mol:	399.159434
ΔH_f, kcal/mol:	-109.71
Dipole, Da:	3.35
IP(EA), eV:	-9.67(1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[3-(cyclopropanecarbonylamino)-4-fluoroanilino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NCCCC1CCCC1)OCC2CC2

DOS

IR

Vibrations