Geometry & MOs

Info

ID:	351515
PubChem CID:	127280403
Reduced:	O3N4C19H32 (1)
Stoich.:	A3B4C19D32 (1)
Weight, g/mol:	398.231791
ΔH_f, kcal/mol:	-157.11
Dipole, Da:	3.26
IP(EA), eV:	-9.22(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[2-[4-(2-pyrrolidin-1-ylacetyl)piperazine-1-carbonyl]phenyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)C(=O)CN2CCCC2)NC(=O)C3CCCC3

DOS

IR

Vibrations