Geometry & MOs

Info

ID:	357283
PubChem CID:	127293916
Reduced:	O2N6C17H30 (1)
Stoich.:	A2B6C17D30 (1)
Weight, g/mol:	376.189926
ΔH_f, kcal/mol:	-44.95
Dipole, Da:	4.1
IP(EA), eV:	-8.48(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2CCN(C2)C(=O)NC3=NN(C=C3)CCOC

DOS

IR

Vibrations