Geometry & MOs

Info

ID:	74668
PubChem CID:	48422267
Reduced:	FNO2C16H22 (1)
Stoich.:	ABC2D16E22 (1)
Weight, g/mol:	406.200491
ΔH_f, kcal/mol:	-103.19
Dipole, Da:	4.18
IP(EA), eV:	-9.38(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[(1-benzylpyrazol-4-yl)methyl-methylamino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)F)N(C)C(=O)C(C)OCC2CC2

DOS

IR

Vibrations