Geometry & MOs

Info

ID:	18485
PubChem CID:	541669
Reduced:	N2O4C11H22 (1)
Stoich.:	A2B4C11D22 (1)
Weight, g/mol:	246.157957
ΔH_f, kcal/mol:	-222.41
Dipole, Da:	5.23
IP(EA), eV:	-9.83(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-(1-hydroxypropan-2-ylamino)-1-oxopropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(CO)NC(=O)C(C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations