Geometry & MOs

Info

ID:	338023
PubChem CID:	127258654
Reduced:	NO3C11H21 (1)
Stoich.:	AB3C11D21 (1)
Weight, g/mol:	263.152144
ΔH_f, kcal/mol:	-168.72
Dipole, Da:	1.66
IP(EA), eV:	-9.82(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-formyl-2-methyl-6-phenylhexan-2-yl) carbamate

Drug info:

PubChemData

Smile

CC(C)CC(CC(C)(C)OC(=O)N)C=O

DOS

IR

Vibrations