Geometry & MOs

Info

ID:	340181
PubChem CID:	127262190
Reduced:	NO6C14H25 (1)
Stoich.:	AB6C14D25 (1)
Weight, g/mol:	299.220892
ΔH_f, kcal/mol:	-306.71
Dipole, Da:	3.57
IP(EA), eV:	-10.11(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4S)-4-(1,4-diazepane-1-carbonyl)-2,5-dimethylhexan-2-yl] carbamate

Drug info:

PubChemData

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C[C@H]([C@H](CC(C)(C)OC(=O)N)C12OCC(CO1)(CO2)C)O

DOS

IR

Vibrations