Geometry & MOs

Info

ID:	350501
PubChem CID:	127277863
Reduced:	SO2N3C16H29 (1)
Stoich.:	AB2C3D16E29 (1)
Weight, g/mol:	285.114713
ΔH_f, kcal/mol:	-113.21
Dipole, Da:	7.67
IP(EA), eV:	-8.92(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-propanoyl-1,3-thiazolidine-4-carbonyl)-1,4-diazepan-5-one

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)NCC(C)N2CCC(CC2)C

DOS

IR

Vibrations