Geometry & MOs

Info

ID:	350210
PubChem CID:	127277288
Reduced:	N3O3C18H31 (1)
Stoich.:	A3B3C18D31 (1)
Weight, g/mol:	364.247441
ΔH_f, kcal/mol:	-155.83
Dipole, Da:	4.01
IP(EA), eV:	-9.46(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(2-methylpropanoyl)-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(CNC(=O)NC2CCN(CC2)C(=O)C3CC3)O

DOS

IR

Vibrations