Geometry & MOs

Info

ID:	189532
PubChem CID:	77868617
Reduced:	SN4O4C19H24 (1)
Stoich.:	AB4C4D19E24 (1)
Weight, g/mol:	649.296342
ΔH_f, kcal/mol:	-126.42
Dipole, Da:	7.15
IP(EA), eV:	-9.0(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[3-[(2,6-difluorophenyl)methyl]-4-methyl-5-[4-(oxan-2-yloxy)phenyl]-2,6-dioxo-1,3-diazinan-1-yl]-1-phenylethyl]carbamate

Drug info:

PubChemData

Smile

COC(=O)C(CC1=CN(C=N1)CC2=CC=CC=C2)NC(=O)CSCCC(=O)N

DOS

IR

Vibrations