Geometry & MOs

Info

ID:	182497
PubChem CID:	76894259
Reduced:	N2O2C17H26 (1)
Stoich.:	A2B2C17D26 (1)
Weight, g/mol:	298.236876
ΔH_f, kcal/mol:	-94.6
Dipole, Da:	4.11
IP(EA), eV:	-9.02(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-amino-3,3-dimethylbutanoyl)-1,4-diazepan-1-yl]-N,N-dimethylacetamide

Drug info:

PubChemData

Smile

CN(CC1CCCCC1)C(=O)C(CC2=CC=C(C=C2)O)N

DOS

IR

Vibrations