Geometry & MOs

Info

ID:	147105
PubChem CID:	53786758
Reduced:	OSN2C7H14 (1)
Stoich.:	ABC2D7E14 (1)
Weight, g/mol:	202.110613
ΔH_f, kcal/mol:	-33.63
Dipole, Da:	2.17
IP(EA), eV:	-8.45(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-propan-2-yl-5H-1,4-benzodiazepin-2-one

Drug info:

PubChemData

Smile

C1CCN(C1)C2NCCOS2

DOS

IR

Vibrations