Geometry & MOs

Info

ID:	367323
PubChem CID:	127324138
Reduced:	FO2N5C19H24 (1)
Stoich.:	AB2C5D19E24 (1)
Weight, g/mol:	372.252526
ΔH_f, kcal/mol:	-84.91
Dipole, Da:	3.76
IP(EA), eV:	-9.55(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-5-oxo-7-phenyl-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)NC3CCCOC4=C3C=C(C=C4)F

DOS

IR

Vibrations