Geometry & MOs

Info

ID:	433879
PubChem CID:	135174022
Reduced:	NPO4F5H23C24 (1)
Stoich.:	ABC4D5E23F24 (1)
Weight, g/mol:	293.199094
ΔH_f, kcal/mol:	-392.9
Dipole, Da:	7.62
IP(EA), eV:	-9.33(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-methyl-1-[(2-methylphenyl)methoxy]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1COCC(C)(C)NP(=O)(OC2=CC=CC=C2)OC3=C(C(=C(C(=C3F)F)F)F)F

DOS

IR

Vibrations