Geometry & MOs

Info

ID:	371109
PubChem CID:	127342511
Reduced:	O2N5C15H29 (1)
Stoich.:	A2B5C15D29 (1)
Weight, g/mol:	349.120861
ΔH_f, kcal/mol:	-106.88
Dipole, Da:	3.15
IP(EA), eV:	-8.39(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(1-methyl-6-oxopiperidin-3-yl)-1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CC(CN1CCN(CC1)C)NC(=O)NC2CCC(=O)N(C2)C

DOS

IR

Vibrations