Geometry & MOs

Info

ID:	75564
PubChem CID:	48423665
Reduced:	O2N3C19H27 (1)
Stoich.:	A2B3C19D27 (1)
Weight, g/mol:	393.18009
ΔH_f, kcal/mol:	-21.83
Dipole, Da:	7.52
IP(EA), eV:	-9.02(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C(=O)N(CCN(C)C)CC1=CC=C(C=C1)C#N)OCC2CC2

DOS

IR

Vibrations