Geometry & MOs

Info

ID:	361024
PubChem CID:	127301901
Reduced:	N2O2C9H14 (2)
Stoich.:	A2B2C9D14 (2)
Weight, g/mol:	310.146347
ΔH_f, kcal/mol:	-194.47
Dipole, Da:	4.9
IP(EA), eV:	-9.45(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[(3-morpholin-4-ylthiolan-3-yl)methyl]-1H-imidazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CCC(=O)N2CCN(CC2)C(=O)CN3CC(=O)NC3=O

DOS

IR

Vibrations