Geometry & MOs

Info

ID:	355931
PubChem CID:	127290783
Reduced:	O2N4C15H24 (1)
Stoich.:	A2B4C15D24 (1)
Weight, g/mol:	362.231791
ΔH_f, kcal/mol:	-41.71
Dipole, Da:	3.95
IP(EA), eV:	-9.02(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-oxoethyl]morpholine-2-carbonitrile

Drug info:

PubChemData

Smile

C1CC1N2CCC(CC2)NC(=O)CN3CCOC(C3)C#N

DOS

IR

Vibrations