Geometry & MOs

Info

ID:	391495
PubChem CID:	135005811
Reduced:	NO4C16H21 (1)
Stoich.:	AB4C16D21 (1)
Weight, g/mol:	309.157623
ΔH_f, kcal/mol:	-69.93
Dipole, Da:	4.89
IP(EA), eV:	-9.76(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(4-hydroxyphenyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate

Drug info:

PubChemData

Smile

C1CCC(CC1)[C@@H](C[C@@H](C2=CC=CC=C2)O[N+](=O)[O-])C=O

DOS

IR

Vibrations