Geometry & MOs

Info

ID:	283836
PubChem CID:	104011575
Reduced:	ON2C17H26 (1)
Stoich.:	AB2C17D26 (1)
Weight, g/mol:	273.184112
ΔH_f, kcal/mol:	-9.86
Dipole, Da:	2.87
IP(EA), eV:	-8.72(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(3-amino-2,3-dihydro-1H-inden-1-yl)-1,4-diazepan-1-yl]ethanone

Drug info:

PubChemData

Smile

CC(C1CC1)N(CCOC)C2CC(C3=CC=CC=C23)N

DOS

IR

Vibrations