Geometry & MOs

Info

ID:	353476
PubChem CID:	127285035
Reduced:	O2N3C18H29 (1)
Stoich.:	A2B3C18D29 (1)
Weight, g/mol:	351.198048
ΔH_f, kcal/mol:	-90.55
Dipole, Da:	5.65
IP(EA), eV:	-9.12(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-N-[(4-pyrrolidin-1-yloxan-4-yl)methyl]-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(C#N)C(=O)NCC2(CCOCC2)N3CCCC3

DOS

IR

Vibrations