Geometry & MOs

Info

ID:	365482
PubChem CID:	127317902
Reduced:	ON2C9H16 (2)
Stoich.:	AB2C9D16 (2)
Weight, g/mol:	270.205576
ΔH_f, kcal/mol:	-91.35
Dipole, Da:	5.86
IP(EA), eV:	-8.86(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(dimethylamino)-1-oxopropan-2-yl]-4,7-dimethyl-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1(CCCC1)CNC(=O)NCC2CCN(C2)C3CC3

DOS

IR

Vibrations