Geometry & MOs

Info

ID:	192125
PubChem CID:	78232682
Reduced:	SO2N3C23H29 (1)
Stoich.:	AB2C3D23E29 (1)
Weight, g/mol:	363.161663
ΔH_f, kcal/mol:	-51.82
Dipole, Da:	5.07
IP(EA), eV:	-8.2(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-[(5,6-dimethyl-4-oxo-4aH-thieno[2,3-d]pyrimidin-2-yl)methyl]-2-methoxyacetamide

Drug info:

PubChemData

Smile

CC1=C(SC2C1C(=O)NC(N2)CN(C3CCCC3)C(=O)C=CC4=CC=CC=C4)C

DOS

IR

Vibrations