Geometry & MOs

Info

ID:	397597
PubChem CID:	135030444
Reduced:	NSiO2C18H29 (1)
Stoich.:	ABC2D18E29 (1)
Weight, g/mol:	611.347155
ΔH_f, kcal/mol:	-119.41
Dipole, Da:	3.14
IP(EA), eV:	-8.96(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-1,6-diphenylhexan-2-yl]-3-methyl-2-(3-oxo-2,5-dihydro-1,2,4-triazin-4-yl)butanamide

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)O[C@@H]1CC(N(C1)CC2=CC=CC=C2)C=O

DOS

IR

Vibrations