Geometry & MOs

Info

ID:	358119
PubChem CID:	127295664
Reduced:	OSN5C20H33 (1)
Stoich.:	ABC5D20E33 (1)
Weight, g/mol:	281.210327
ΔH_f, kcal/mol:	-25.88
Dipole, Da:	5.07
IP(EA), eV:	-8.56(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

morpholin-4-yl-(3-pyrrolidin-1-ylazepan-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CCCN(C1)CC2=CSC(=N2)NC(=O)N3CCC(C3)N4CCCCC4

DOS

IR

Vibrations