Geometry & MOs

Info

ID:	307996
PubChem CID:	125311176
Reduced:	SO2N5H25C27 (1)
Stoich.:	AB2C5D25E27 (1)
Weight, g/mol:	242.101505
ΔH_f, kcal/mol:	76.74
Dipole, Da:	7.92
IP(EA), eV:	-8.64(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-methyl-N-[(5R)-4-(methylamino)-2,6-dioxo-5H-pyrimidin-5-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=C5C=CC=CC5=NC4)C

DOS

IR

Vibrations