Geometry & MOs

Info

ID:	319263
PubChem CID:	126655464
Reduced:	ON4C8H16 (1)
Stoich.:	AB4C8D16 (1)
Weight, g/mol:	270.148061
ΔH_f, kcal/mol:	-19.31
Dipole, Da:	6.4
IP(EA), eV:	-8.89(1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-benzylpyrazol-3-yl)-1,4-diazepan-5-one

Drug info:

PubChemData

Smile

C1CNNC1N2CCC(=O)NCC2

DOS

IR

Vibrations